Drug-likeness Properties
sLogP
2.2982
HBD
1
HBA
4
AS118188-G1
Halides
Ketones
Amines
Benzene
Methyl 2-(4-bromobenzoyl)-3-(methylamino)but-2-enoate 97%
CAS: 1423699-80-2
Molecular Formula
C13H14BrNO3
Molecular Weight
312.16
MDL
MFCD30729997
Unit Size
Price per 1 g
€655.00
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PRODUCT ATTACHED TO REQUEST:
Methyl 2-(4-bromobenzoyl)-3-(methylamino)but-2-enoate 97%
Catalogue Number: AS118188-G1
C.A.S / related C.A.S
1423699-80-2
Quality Guarantee
All products are tested and certified with CoA available upon request.
AS118188-G1
General Information
| Catalog #: | AS118188-G1 |
|---|---|
| Formula: | C13H14BrNO3 |
| Mass: | 312.16 |
| C.A.S. / related C.A.S: | 1423699-80-2 |
| MDL: | MFCD30729997 |
| Appearance: | powder or crystals |
| Colour: | white to off-white |
| Hazardous Classification: | Achtung / Warning |
| Storage Temp: | 2-7°C Kühlschrank / Refrigerate |
| Dangerous Goods in Excepted Quantities: | |
| Tariff Code: | 2925290090 |
| Stock: | 0 |
| Material Safety Data Sheet: |
Computational Information
| SlogP: | 2.2982 |
|---|---|
| LabuteASA: | 114.1503941 |
| TPSA: | 55.4 |
| NumRotatableBonds: | 4 |
| NumHBD: | 1 |
| NumHBA: | 4 |
| NumHeavyAtoms: | 18 |
| NumRings: | 1 |